N-[4-(phenylmethyl)piperazin-1-yl]carbothioylfuran-2-carboxamide hydrochloride

Systemtic Name: N-[4-(phenylmethyl)piperazin-1-yl]carbothioylfuran-2-carboxamide hydrochloride Openeye Name: N-(4-benzylpiperazine-1-carbothioyl)furan-2-carboxamide hydrochloride CAS Name: N-[[4-(phenylmethyl)-1-piperazinyl]-sulfanylidenemethyl]-2-furancarboxamide hydrochloride IUPAC Name: N-(4-benzylpiperazine-1-carbothioyl)furan-2-carboxamide hydrochloride Traditional Name: N-(4-benzylpiperazine-1-carbothioyl)-2-furamide hydrochloride Formula: C17H20ClN3O2S MolecularWeight: 365.8776

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=S)NC(=O)C3=CC=CO3.Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=S)NC(=O)C3=CC=CO3.Cl

InChI

InChI=1S/C17H19N3O2S.ClH/c21-16(15-7-4-12-22-15)18-17(23)20-10-8-19(9-11-20)13-14-5-2-1-3-6-14;/h1-7,12H,8-11,13H2,(H,18,21,23);1H